Vitas-M small molecule compound
2-methoxy-5-[(E)-(1-oxo-3,4-dihydronaphthalen-2(1H)-ylidene)methyl]benzyl acetate
Catalog ID
STL168799
SMILES COc1ccc(cc1COC(=O)C)/C=C/1\CCc2c(C1=O)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H20O4 MW 336.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O4/c1-14(22)25-13-18-12-15(7-10-20(18)24-2)11-17-9-8-16-5-3-4-6-19(16)21(17)23/h3-7,10-12H,8-9,13H2,1-2H3/b17-11+InChIKey
ARDMODZKQCRAJV-GZTJUZNOSA-NSynonyms
827594-65-0(2METHOXY5((1OXO(234DIHYDRONAPHTHYLIDENE))METHYL)PHENYL)METHYLACETATE
(2METHOXY5((E)(1OXO34DIHYDRONAPHTHALEN2YLIDENE)METHYL)PHENYL)METHYLACETATE
2methoxy5((E)(1oxo34dihydronaphthalen2(1H)ylidene)methyl)benzylacetate
827594650
CC(=O)OCC1=C(C=CC(=C1)C=C2CCC3=CC=CC=C3C2=O)OC
COc1ccc(cc1COC(=O)C)C=C1CCc2c(C1=O)cccc2
InChI=1SC21H20O4c114(22)2513181215(71020(18)242)11179816534619(16)21(17)23h371012H8913H212H3b1711+
MFCD04053736
ZINC000002780668
ZINC02780668
ZINC2780668
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